SCHEMBL10698317

SCHEMBL10698317

C=C(C)C(OOCCCC)OC(=O)OC(OOCCCC)C(=C)C

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
TSHR P16473 3/20 0.36
HPGD P15428 1/20 0.34
ATM Q13315 1/20 0.32
CES2 O00748 2/20 0.31
PLA2G2C Q5R387 1/20 0.30
LMNA P02545 2/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10698192 0.93 TSHR (0.45) TSHRCES2PLA2G2CLMNA
SCHEMBL10698322 0.88 ALDH1A1 (0.37) ALDH1A1TSHRHPGDATMCES2
SCHEMBL10698196 0.82 TSHR (0.44) TSHRCES2PLA2G2CLMNA
SCHEMBL4963097 0.72 TSHR (0.42) ALDH1A1TSHRHPGDATMPLA2G2C
SCHEMBL11231305 0.69 SMPD1 (0.43) LMNA
SCHEMBL11224048 0.69 SMPD1 (0.43) LMNA
SCHEMBL7562429 0.69 ALDH1A1 (0.39) ALDH1A1TSHRHPGDATM
Acetone SCHEMBL8477263 0.68 ALDH1A1 (0.59) ALDH1A1TSHRHPGDATMCES2
SCHEMBL28942992 0.67 LMNA (0.41) ALDH1A1TSHRHPGDATMPLA2G2C
Acetic Acid SCHEMBL28705402 0.67 ALDH1A1 (0.43) ALDH1A1TSHRHPGDATMCES2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0289933-A2 Graft polymerization precurser and method manufacturing the same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1988-11-09 EP disclosed
EP-0277608-A2 Graft polymerization preformer and method of manufacturing the same NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1988-08-10 EP disclosed